3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)propanamide

Systemtic Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)propanamide Openeye Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)propanamide CAS Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolyl]-N-(4-methyl-1-piperazin-4-iumyl)propanamide IUPAC Name: 3-[1-(3-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)propanamide Traditional Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)propionamide Formula: C20H30N5O2+ MolecularWeight: 372.4845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C20H29N5O2/c1-15-19(8-9-20(26)22-24-12-10-23(3)11-13-24)16(2)25(21-15)17-6-5-7-18(14-17)27-4/h5-7,14H,8-13H2,1-4H3,(H,22,26)/p+1